1-(4-pyrrolidin-1-ylphenyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine

C16H20N4 — CID 64856886

IUPAC1-(4-pyrrolidin-1-ylphenyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESc1cc(-n2cnc3c2CCNC3)ccc1N1CCCC1
InChIInChI=1S/C16H20N4/c1-2-10-19(9-1)13-3-5-14(6-4-13)20-12-18-15-11-17-8-7-16(15)20/h3-6,12,17H,1-2,7-11H2
InChIKeyGONXNQTURMOEPC-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.12
Rot. Bonds2

About 1-(4-pyrrolidin-1-ylphenyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine

1-(4-pyrrolidin-1-ylphenyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (PubChem CID 64856886) has the molecular formula C16H20N4 and a molecular weight of 268.36 g/mol. Its IUPAC name is 1-(4-pyrrolidin-1-ylphenyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name1-(4-pyrrolidin-1-ylphenyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
PubChem CID64856886
Molecular FormulaC16H20N4
Molecular Weight268.36 g/mol
Exact Mass268.17
IUPAC Name1-(4-pyrrolidin-1-ylphenyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESc1cc(-n2cnc3c2CCNC3)ccc1N1CCCC1
InChIInChI=1S/C16H20N4/c1-2-10-19(9-1)13-3-5-14(6-4-13)20-12-18-15-11-17-8-7-16(15)20/h3-6,12,17H,1-2,7-11H2
InChIKeyGONXNQTURMOEPC-UHFFFAOYSA-N
XLogP2.12
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Analyze 1-(4-pyrrolidin-1-ylphenyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(4-pyrrolidin-1-ylphenyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The IUPAC name of 1-(4-pyrrolidin-1-ylphenyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (CID 64856886) is 1-(4-pyrrolidin-1-ylphenyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.
What is the SMILES notation for 1-(4-pyrrolidin-1-ylphenyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The canonical SMILES for 1-(4-pyrrolidin-1-ylphenyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is c1cc(-n2cnc3c2CCNC3)ccc1N1CCCC1.
What is the InChIKey of 1-(4-pyrrolidin-1-ylphenyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The InChIKey is GONXNQTURMOEPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4/c1-2-10-19(9-1)13-3-5-14(6-4-13)20-12-18-15-11-17-8-7-16(15)20/h3-6,12,17H,1-2,7-11H2.
What are the key properties of 1-(4-pyrrolidin-1-ylphenyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
1-(4-pyrrolidin-1-ylphenyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine has a molecular weight of 268.36 g/mol, XLogP of 2.12, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-pyrrolidin-1-ylphenyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is sourced from PubChem (CID 64856886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).